ChemSpider 2D Image | 4-chloro-1-ethyl-5-methylpyrazole | C6H9ClN2

4-chloro-1-ethyl-5-methylpyrazole

  • Molecular FormulaC6H9ClN2
  • Average mass144.602 Da
  • Monoisotopic mass144.045425 Da
  • ChemSpider ID21800390

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1172915-66-0 [RN]
1H-Pyrazole, 4-chloro-1-ethyl-5-methyl- [ACD/Index Name]
4-Chlor-1-ethyl-5-methyl-1H-pyrazol [German] [ACD/IUPAC Name]
4-Chloro-1-ethyl-5-methyl-1H-pyrazole [ACD/IUPAC Name]
4-Chloro-1-éthyl-5-méthyl-1H-pyrazole [French] [ACD/IUPAC Name]
4-chloro-1-ethyl-5-methylpyrazole
AGN-PC-050H8X
ALBB-004438
CTK6B3694
MolPort-006-066-951
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD12026907 [DBID]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 202.3±20.0 °C at 760 mmHg
    Vapour Pressure: 0.4±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 42.1±3.0 kJ/mol
    Flash Point: 76.1±21.8 °C
    Index of Refraction: 1.543
    Molar Refractivity: 38.9±0.5 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.11
    ACD/LogD (pH 5.5): 2.15
    ACD/BCF (pH 5.5): 25.15
    ACD/KOC (pH 5.5): 350.08
    ACD/LogD (pH 7.4): 2.15
    ACD/BCF (pH 7.4): 25.15
    ACD/KOC (pH 7.4): 350.08
    Polar Surface Area: 18 Å2
    Polarizability: 15.4±0.5 10-24cm3
    Surface Tension: 34.4±7.0 dyne/cm
    Molar Volume: 123.4±7.0 cm3

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